SCHEMBL6887196

SCHEMBL6887196

CC1CCC(C(=O)Nc2ccc(-c3cnc(-c4ccccc4NC(=O)C4C5CC6CC(C5)CC4C6)[nH]3)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PARP14 Q460N5 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
GSK3B P49841 1/20 0.36
SCN3A Q9NY46 2/20 0.35
SCN9A Q15858 1/20 0.35
JAK2 O60674 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
ABL1 P00519 1/20 0.34
NR2E3 Q9Y5X4 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6888532 0.93 MAPT (0.37) MAPTALDH1A1MEN1KMT2APARP14
SCHEMBL6883829 0.91 PTPN1 (0.44) MAPTALDH1A1KMT2ARXFP1SCN3A
SCHEMBL6027333 0.90 BRD4 (0.42) MAPTALDH1A1MEN1KMT2ARXFP1
SCHEMBL6026610 0.83 BRD4 (0.44) MAPTALDH1A1MEN1KMT2ARXFP1
SCHEMBL6026685 0.81 PTPN1 (0.44) MAPTALDH1A1KMT2ARXFP1SCN3A
SCHEMBL6887943 0.80 RAB9A (0.38) MAPTALDH1A1MEN1KMT2ASCN3A
SCHEMBL6886857 0.78 EPHX2 (0.43) ALDH1A1MEN1KMT2AJAK2SMN1; SMN2
SCHEMBL6884593 0.77 NPC1 (0.44) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL6888859 0.76 ITGA4 (0.41) MAPTALDH1A1PTPN1NPC1RAB9A
SCHEMBL6028319 0.76 PTPN1 (0.54) ALDH1A1GSK3BSCN3ASCN9APTPN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229927-A1 Imidazole derivatives for treatment of allergic and hyperproliferative disorders AVANIR PHARMACEUTICALS 2004-11-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040229927-A1 Imidazole derivatives for treatment of allergic and hyperproliferative disorders ICOS, TSLP, IKZF3 MAPT 3569/4885ALDH1A1 863/4885MEN1 2429/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.